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N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]acetamide

N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]acetamide

CAS: 3946-01-8

Formula: C9H17NO6

SMILES: CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1NC(C)=O

IUPAC: N-[(2R,3R,4R,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-methoxyoxan-3-yl]acetamide

InChI: InChI=1S/C9H17NO6/c1-4(12)10-6-8(14)7(13)5(3-11)16-9(6)15-2/h5-9,11,13-14H,3H2,1-2H3,(H,10,12)/t5-,6-,7-,8-,9-/m1/s1

Composition: C (45.95%), H (7.28%), N (5.95%), O (40.81%)

Molar Mass: 235.236

Atom Count: 33

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 5
Exact Mass 235.105587271
Formal Charge 0
FSP3 0.89
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 6
Hydrogen Bond Donor Count 4
InChIKey ZEVOCXOZYFLVKN-JGKVKWKGSA-N
Lipinski's Rule of Five 1
Molar Refractivity 51.78
Topological Polar Surface Area 108.25
Polarizability 21.27
Ring Count 1
Rotatable Bond Count 3

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95% <5 Days 3946-01-8 $738.00-$923.00$738.00$923.00
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